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Molecule
ID:125605
Structure
Similarity
Functional Group
Text
General Information
Structure
Molecular Formula
C₂H₃IO
Molecular Mass
169.94909
Exact Mass
169.92286272
Charge
0
InChI
InChI=1S/C2H3IO/c1-2(3)4/h1H3
InChIKey
LEKJTGQWLAUGQA-UHFFFAOYSA-N
Canonic Smiles
CC(=O)I
Isomeric Smiles
CC(=O)I
Calculated Properties
JChem
Acid pKa
19.113499
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
0.44729418
LogD (pH = 7.4)
0.44729418
Log P
0.44729418
Molar Refractivity
23.7067
Polarizability
9.935146
Polar Surface Area
17.07
Rotatable Bonds
0
Lipinski's Rule of Five
true
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General Information
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Acetyl_iodide
PubChem
10483
Names and Identifiers
IUPAC Traditional name
acetyl iodide
Synonyms
Acetyl iodide
IUPAC Systematic name
Acetyl iodide
IUPAC name
acetyl iodide
Registration numbers
CAS Number
507-02-8
EC Number
208-062-2
PubChem CID
10483
Chemspider ID
10051
Wikipedia Title
Acetyl_iodide
PubChem SID
162219955
Properties
Physical Property
Boiling Point
107.85°C (381K)
Source
Solubility
Decomposes in water
Source
Std enthalpy of formation
-163.18--161.42 kJ mol
-1
Source
Safety Information
UN Number
1898
Source
Molecule Details
Wikipedia
Acetyl_iodide
References
PubChem Literature
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Bioactivity
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Registration numbers
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PubChem CID
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Chemspider ID
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PubChem SID